1-(Prop-2-en-1-yl)cyclopropane-1-sulfonyl chloride

C₆H₉ClO₂SCAS 923032-59-1180.65 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₉ClO₂S
Molar mass: 180.65 g/mol
Exact mass: 180.0012 Da
logP: 1.66Crippen estimate
Polar surface area: 34.1 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 3

Hazards

Danger

H314 Causes severe skin burns and eye damage100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P403+P233, P405, P501

Identifiers

CAS number

923032-59-1

SMILES

C=CCC1(S(=O)(=O)Cl)CC1

InChIKey

AQYNREAFYINZPS-UHFFFAOYSA-N

InChI

InChI=1S/C6H9ClO2S/c1-2-3-6(4-5-6)10(7,8)9/h2H,1,3-5H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names

1-Allylcyclopropanesulfonyl chloride
Cyclopropanesulfonyl chloride, 1-(2-propen-1-yl)-
1-(2-Propen-1-yl)cyclopropanesulfonyl chloride
1-Allylcyclopropane-1-sulfonyl Chloride
1-Allyl-1-cyclopropylsulfonyl chloride

Work with 1-(Prop-2-en-1-yl)cyclopropane-1-sulfonyl chloride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Trichloromethanesulfonyl chloride2547-61-737 % similar Trifluoromethanesulfonyl chloride421-83-031 % similar 4,4-Dimethyl-1-pentene762-62-931 % similar 1-(2-Propen-1-yl)cyclohexanol1123-34-830 % similar 2,2-Dimethyl-4-pentenal5497-67-630 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook